SCHEMBL11265654

SCHEMBL11265654

Cc1[nH]c2c(c1-c1ccccc1)C(=O)CCC2

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 13/20 0.61
KMT2A Q03164 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
PTK2 Q05397 1/20 0.46
PDGFRA P16234 1/20 0.45
MAPK8 P45983 1/20 0.45
CDK5 Q00535 1/20 0.45
CLK4 Q9HAZ1 1/20 0.45
BUB1 O43683 2/20 0.44
NPC1 O15118 1/20 0.44
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CREBBP Q92793 1/20 0.44
DYRK1A Q13627 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19032173 0.76 BRD4 (0.52) BRD4PDGFRAMAPK8CDK5CLK4
SCHEMBL15328755 0.76 BRD4 (1.00) BRD4CREBBP
SCHEMBL4467904 0.75 MAPT (0.49) BRD4KMT2AL3MBTL1PTK2BUB1
SCHEMBL9803050 0.74 L3MBTL1 (0.48) BRD4KMT2AL3MBTL1PTK2BUB1
SCHEMBL934852 0.73 PTK2 (0.61) BRD4L3MBTL1PTK2NPC1LMNA
SCHEMBL24263871 0.73 BRD4 (0.94) BRD4CREBBP
SCHEMBL31027151 0.68 DYRK1A (0.58) KMT2ALMNAGAAHTTSMN1; SMN2
SCHEMBL6907631 0.68 PTK2 (0.46) BRD4L3MBTL1PTK2LMNATSHR
SCHEMBL23537356 0.68 PARP1 (0.59) BRD4KMT2AL3MBTL1PTK2BUB1
SCHEMBL29824193 0.68 PARP1 (0.59) BRD4KMT2AL3MBTL1PTK2BUB1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0015523-B1 INDOLE DERIVATIVES, THEIR PREPARATION AND THEIR USE FOR MEDICAMENTS Dr. Karl Thomae GmbH (DE) 1982-10-13 EP disclosed
US-4343811-A ATHEROSCLEROSIS BOEHRINGER INGELHEIM GMBH (DE) 1982-08-10 US disclosed
EP-0015523-A1 Indole derivatives, their preparation and their use for medicaments Dr. Karl Thomae GmbH (DE) 1980-09-17 EP disclosed